1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide

C16H22N4O2S2 — CID 47069873

IUPAC1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide
SMILESCCN(CC)c1nc2sc(C(=O)N3CCC(C(N)=O)CC3)cc2s1
InChIInChI=1S/C16H22N4O2S2/c1-3-19(4-2)16-18-14-11(24-16)9-12(23-14)15(22)20-7-5-10(6-8-20)13(17)21/h9-10H,3-8H2,1-2H3,(H2,17,21)
InChIKeyOPNMOKRDUSRZHR-UHFFFAOYSA-N
MW366.51 g/mol
LogP2.54
Rot. Bonds5

About 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide

1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide (PubChem CID 47069873) has the molecular formula C16H22N4O2S2 and a molecular weight of 366.51 g/mol. Its IUPAC name is 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide
PubChem CID47069873
Molecular FormulaC16H22N4O2S2
Molecular Weight366.51 g/mol
Exact Mass366.12
IUPAC Name1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide
SMILESCCN(CC)c1nc2sc(C(=O)N3CCC(C(N)=O)CC3)cc2s1
InChIInChI=1S/C16H22N4O2S2/c1-3-19(4-2)16-18-14-11(24-16)9-12(23-14)15(22)20-7-5-10(6-8-20)13(17)21/h9-10H,3-8H2,1-2H3,(H2,17,21)
InChIKeyOPNMOKRDUSRZHR-UHFFFAOYSA-N
XLogP2.54
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]-5-methylpiperidine-3-carboxylic acid
CID 122117790
[2-(aminomethyl)piperidin-1-yl]-[2-(dimethylamino)thieno[2,3-d][1,3]thiazol-5-yl]methanone;dihydrochloride
CID 119467833
(2-oxooxolan-3-yl) 2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carboxylate
CID 75405859
N-[1-(aminomethyl)cyclopentyl]-2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 119567442
N-(3-amino-2-methylpropyl)-2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 119995828
1-(1-ethyl-5-methylpyrazole-3-carbonyl)piperidine-4-carboxamide
CID 110681708
1-[4-(diethylsulfamoyl)thiophene-2-carbonyl]piperidine-4-carboxamide
CID 27262135
N'-hydroxy-1-(thieno[3,2-b]thiophene-5-carbonyl)piperidine-4-carboximidamide
CID 80745423
1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 750217
N-(2-amino-2-phenylethyl)-2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 119528992
N-(5-amino-2-methylphenyl)-2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 120568686
2-(diethylamino)-N-(2-imidazol-1-ylethyl)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 47069990

Frequently Asked Questions

What is the IUPAC name of 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide (CID 47069873) is 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide is CCN(CC)c1nc2sc(C(=O)N3CCC(C(N)=O)CC3)cc2s1.
What is the InChIKey of 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide?
The InChIKey is OPNMOKRDUSRZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2S2/c1-3-19(4-2)16-18-14-11(24-16)9-12(23-14)15(22)20-7-5-10(6-8-20)13(17)21/h9-10H,3-8H2,1-2H3,(H2,17,21).
What are the key properties of 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide?
1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide has a molecular weight of 366.51 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperidine-4-carboxamide is sourced from PubChem (CID 47069873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).